3793-2944 Screening compound: N-{4-[(2,6-dimethoxypyrimidin-4-yl)sulfamoyl]phenyl}-2-(1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl)acetamide

3793-2944 Screening compound: N-{4-[(2,6-dimethoxypyrimidin-4-yl)sulfamoyl]phenyl}-2-(1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl)acetamide
3793-2944 Screening compound: N-{4-[(2,6-dimethoxypyrimidin-4-yl)sulfamoyl]phenyl}-2-(1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl)acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound 3793-2944
N-{4-[(2,6-dimethoxypyrimidin-4-yl)sulfamoyl]phenyl}-2-(1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl)acetamide

Available from 1 mg

Formats:

  • Glass Vials (4ml Glass Vials VWR #97047-678)
  • 96-tube racks (Matrix #4247 96-well 1.4ml sealed with capmats, empty cols 1 & 12, 100uL of 10mM)

Shiptime: 1 week worldwide delivery in most cases

Compound Identifiers

ChemDiv Compound ID

3793-2944

Molecular Formula

C22H19N5O7S (C22 H19 N5 O7 S)

Compound Name

N-{4-[(2,6-dimethoxypyrimidin-4-yl)sulfamoyl]phenyl}-2-(1,3-dioxo-2,3-dihydro-1H-isoindol-2-yl)acetamide

IUPAC name

N-{4-[(26-dimethoxypyrimidin-4-yl)sulfamoyl]phenyl}-2-(13-dioxo-23-dihydro-1H-isoindol-2-yl)acetamide

SMILES

COc1cc(NS(c(cc2)ccc2NC(CN(C(c2c3cccc2)=O)C3=O)=O)(=O)=O)nc(OC)n1

InChI

InChI=1S/C22H19N5O7S/c1-33-19-11-17(24-22(25-19)34-2)26-35(31,32)14-9-7-13(8-10-14)23-18(28)12-27-20(29)15-5-3-4-6-16(15)21(27)30/h3-11H,12H2,1-2H3,(H,23,28)(H,24,25,26)

InChI Key

ZVUJCELLZSTHHF-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD02333065

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

497.49

Hydrogen Bond Acceptors Count

14.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

9.00

Number of Nitrogen and Oxygen Atoms

12

Partition Coefficient, logP

2.274

Distribution Coefficient, logD

-0.854

Water Solubility, LogSw

-3.20

Polar Surface Area

127.217

Acid Dissociation Constant (pKa)

4.27

Base Dissociation Constant (pKb)

-0.58

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

13.60

3793-2944 in Drug Discovery

Included in Screening Libraries

3D-Biodiversity Library (27607 compounds)

3D-Pharmacophore Based Diversity Library (49813 compounds)

Antibacterial Compounds Library (13827 compounds)

ChemoGenomic Annotated Library for Phenotypic Screening (89798 compounds)

Target Identification, Phenotypic Screening library (TIPS) (27612 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D
Therapeutical areas:
  • Infections
  • Immune system
  • animal

References: we are preparing a list of scientific research reports with 3793-2944 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 3793-2944?
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What is the minimum amount of 3793-2944 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 3793-2944
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 3793-2944
  • 0.5–50 mg of dry powder sample in single glass vials, custom vials
  • DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)

Custom synthesis of 3793-2944 available by request